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S11-1014

IC50 eqBChE 0.15 +/- 0.06 nM, HuBChE 0.080 +/- 0.03 nM

General

Type : Benzamide

Chemical_Nomenclature : N-[[2-(diethylaminomethyl)phenyl]methyl]-3-[(4-fluorobenzoyl)amino]benzamide

Canonical SMILES : CCN(CC)CC1=CC=CC=C1CNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)F

InChI : InChI=1S\/C26H28FN3O2\/c1-3-30(4-2)18-22-9-6-5-8-21(22)17-28-25(31)20-10-7-11-24(16-20)29-26(32)19-12-14-23(27)15-13-19\/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32)

InChIKey : VINBNLJQGNXIFH-UHFFFAOYSA-N

Other name(s) : SCHEMBL23070711

MW : 433.5

Formula : C26H28FN3O2

CAS_number :

PubChem : 39994248

UniChem : VINBNLJQGNXIFH-UHFFFAOYSA-N

IUPHAR :

Wikipedia :

Target

Families : S11-1014 ligand of proteins in family: BCHE

Stucture :

Protein : human-BCHE

References (1)

Title : N-Benzyl Benzamide Derivatives as Selective Sub-Nanomolar Butyrylcholinesterase Inhibitors for Possible Treatment in Advanced Alzheimer's Disease - Du_2022_J.Med.Chem__
Author(s) : Du C , Wang L , Guan Q , Yang H , Chen T , Liu Y , Li Q , Lyu W , Lu X , Chen Y , Liu H , Feng F , Liu W , Liu Z , Li W , Sun H
Ref : Journal of Medicinal Chemistry , : , 2022
Abstract : Du_2022_J.Med.Chem__
ESTHER : Du_2022_J.Med.Chem__
PubMedSearch : Du_2022_J.Med.Chem__
PubMedID: 35969197